N-[3-[6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]butanamide

Systemtic Name: N-[3-[6,8-bis(chloranyl)-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl]phenyl]butanamide Openeye Name: N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]butanamide CAS Name: N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]butanamide IUPAC Name: N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]butanamide Traditional Name: N-[3-(6,8-dichloro-2-methyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl]butyramide Formula: C20H22Cl2N2O MolecularWeight: 377.30748

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)C2CN(CC3=C(C=C(C=C23)Cl)Cl)C

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)C2CN(CC3=C(C=C(C=C23)Cl)Cl)C

InChI

InChI=1S/C20H22Cl2N2O/c1-3-5-20(25)23-15-7-4-6-13(8-15)17-11-24(2)12-18-16(17)9-14(21)10-19(18)22/h4,6-10,17H,3,5,11-12H2,1-2H3,(H,23,25)